Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.37 |
| ▸ | MTOR | P42345 | 1/20 | 0.37 |
| ▸ | PRKDC | P78527 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | BTK | Q06187 | 2/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 2/20 | 0.35 |
| ▸ | JAK1 | P23458 | 2/20 | 0.35 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.35 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.35 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.34 |
| ▸ | HTR3A | P46098 | 1/20 | 0.34 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | PLD2 | O14939 | 1/20 | 0.33 |
| ▸ | PLD1 | Q13393 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL22902459 | 0.86 | OPRM1 (0.35) | KMT2AOPRM1HRH1HRH4ALDH1A1 | |
| SCHEMBL29737046 | 0.83 | SLC2A1 (0.36) | OPRM1HRH1HRH4JAK2JAK1 | |
| SCHEMBL31280171 | 0.82 | SLC2A1 (0.35) | OPRM1HRH1HRH4JAK2JAK1 | |
| SCHEMBL32664297 | 0.82 | SLC2A1 (0.35) | OPRM1HRH1HRH4JAK2JAK1 | |
| SCHEMBL18289976 | 0.81 | HTR6 (0.40) | OPRM1BTKHRH1HRH4JAK2 | |
| SCHEMBL30111801 | 0.81 | HTR6 (0.40) | OPRM1BTKHRH1HRH4JAK2 | |
| SCHEMBL29471042 | 0.81 | OPRM1 (0.46) | PIK3CAMTORPRKDCOPRM1ALDH1A1 | |
| SCHEMBL32664570 | 0.80 | SLC2A1 (0.35) | PIK3CAMTORPRKDCOPRM1HRH1 | |
| SCHEMBL31279004 | 0.80 | SLC2A1 (0.35) | PIK3CAMTORPRKDCOPRM1HRH1 | |
| SCHEMBL31279119 | 0.80 | BACE1 (0.36) | PIK3CAMTORPRKDCOPRM1BTK |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021011428-A1 | HETEROCYCLIC KINASE INHIBITORS | GB005, INC. (US) | 2021-01-21 | — | — | WO | disclosed |